(3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl) 4-methylbenzenesulfonate

Systemtic Name: (3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl) 4-methylbenzenesulfonate Openeye Name: (3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl) ester IUPAC Name: (3-methoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-methoxy-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-yl) ester Formula: C19H22O4S MolecularWeight: 346.44058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCC3=C(C2)C=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CCCC3=C(C2)C=C(C=C3)OC

InChI

InChI=1S/C19H22O4S/c1-14-6-10-19(11-7-14)24(20,21)23-18-5-3-4-15-8-9-17(22-2)12-16(15)13-18/h6-12,18H,3-5,13H2,1-2H3